REMARK  Name = BDB015911
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.843   1.220  -0.251  0.00  0.00    +0.132 A 
ATOM      2  C   LIG    1        1.329   2.363  -0.884  0.00  0.00    +0.060 A 
ATOM      3  C   LIG    1        0.380   3.124  -1.541  0.00  0.00    +0.126 A 
ATOM      4  N   LIG    1       -0.928   2.808  -1.625  0.00  0.00    -0.235 NA
ATOM      5  C   LIG    1       -1.300   1.670  -1.017  0.00  0.00    +0.162 A 
ATOM      6  N   LIG    1       -0.457   0.867  -0.336  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1        2.725   2.781  -0.892  0.00  0.00    +0.097 A 
ATOM      8  N   LIG    1        3.062   4.081  -0.835  0.00  0.00    -0.171 NA
ATOM      9  N   LIG    1        4.406   4.089  -0.871  0.00  0.00    -0.274 N 
ATOM     10  C   LIG    1        5.109   5.348  -0.819  0.00  0.00    +0.172 C 
ATOM     11  C   LIG    1        4.953   2.847  -0.962  0.00  0.00    +0.108 A 
ATOM     12  C   LIG    1        3.892   1.974  -0.987  0.00  0.00    +0.049 A 
ENDBRANCH   2   7
BRANCH   5  13
ATOM     13  C   LIG    1       -2.720   1.272  -1.094  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -3.177   0.065  -0.523  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -4.524  -0.329  -0.586  0.00  0.00    -0.014 A 
ATOM     16  C   LIG    1       -5.441   0.507  -1.232  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -5.019   1.705  -1.807  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -3.676   2.079  -1.738  0.00  0.00    +0.011 A 
BRANCH  15  19
ATOM     19  C   LIG    1       -4.971  -1.576   0.012  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1       -4.206  -2.718   0.145  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.006  -3.651   0.737  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -4.652  -5.007   1.079  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -6.246  -3.204   1.002  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -6.223  -1.944   0.558  0.00  0.00    +0.142 A 
ENDBRANCH  15  19
ENDBRANCH   5  13
BRANCH   1  25
ATOM     25  N   LIG    1        1.712   0.379   0.485  0.00  0.00    -0.327 N 
ATOM     26  H   LIG    1        2.241   0.970   1.127  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1        1.037  -0.712   1.209  0.00  0.00    +0.121 C 
BRANCH  27  28
ATOM     28  C   LIG    1        2.083  -1.575   1.927  0.00  0.00    +0.123 C 
BRANCH  28  31
ATOM     29  C   LIG    1        5.050  -3.325   0.354  0.00  0.00    +0.109 C 
ATOM     30  C   LIG    1        4.015  -3.005   1.398  0.00  0.00    +0.210 C 
ATOM     31  N   LIG    1        3.076  -2.087   0.999  0.00  0.00    -0.314 N 
ATOM     32  H   LIG    1        3.249  -1.521   0.176  0.00  0.00    +0.149 HD
ATOM     33  O   LIG    1        4.027  -3.522   2.510  0.00  0.00    -0.276 OA
ENDBRANCH  28  31
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   1  25
TORSDOF 7